Detailed information for compound 887704

Basic information

Technical information
  • TDR Targets ID: 887704
  • Name: N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]-4- methylbenzenesulfonamide
  • MW: 321.41 | Formula: C17H20FNO2S
  • H donors: 1 H acceptors: 2 LogP: 3.93 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)S(=O)(=O)NC(Cc1ccc(cc1)F)(C)C
  • InChi: 1S/C17H20FNO2S/c1-13-4-10-16(11-5-13)22(20,21)19-17(2,3)12-14-6-8-15(18)9-7-14/h4-11,19H,12H2,1-3H3
  • InChiKey: WWSBIVHGVGRDKB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[2-(4-fluorophenyl)-1,1-dimethyl-ethyl]-4-methyl-benzenesulfonamide
  • N-[2-(4-fluorophenyl)-1,1-dimethylethyl]-4-methylbenzenesulfonamide
  • N-[1-(4-fluorophenyl)-2-methyl-propan-2-yl]-4-methyl-benzenesulfonamide

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trypanosoma cruzi adenosine kinase, putative 0.0308 0.0268 1
Trypanosoma brucei ribokinase, putative 0.0308 0.0268 1
Onchocerca volvulus 0.8021 1 1
Schistosoma mansoni biogenic amine (5HT) receptor 0.0173 0.0098 0.2784
Loa Loa (eye worm) hypothetical protein 0.0187 0.0115 0.0115
Schistosoma mansoni adenosine kinase 0.0308 0.0268 1
Echinococcus multilocularis adenosine kinase 0.0308 0.0268 1
Echinococcus multilocularis ribokinase 0.0308 0.0268 1
Echinococcus granulosus pseudouridine metabolizing bifunctional protein 0.0308 0.0268 1
Trypanosoma cruzi adenosine kinase, putative 0.0308 0.0268 1
Mycobacterium tuberculosis Adenosine kinase 0.0308 0.0268 0.5
Trypanosoma brucei adenosine kinase, putative 0.0308 0.0268 1
Schistosoma mansoni nAChR subunit (ShAR1-alpha-like) 0.0227 0.0166 0.5666
Mycobacterium ulcerans carbohydrate kinase CbhK 0.0308 0.0268 0.5
Leishmania major adenosine kinase, putative 0.0308 0.0268 1
Toxoplasma gondii kinase, pfkB family protein 0.0308 0.0268 0.5
Leishmania major tagatose-6-phosphate kinase-like protein 0.0308 0.0268 1
Trichomonas vaginalis ribokinase, putative 0.0308 0.0268 0.5
Toxoplasma gondii kinase, pfkB family protein 0.0308 0.0268 0.5
Leishmania major adenosine kinase-like protein 0.0308 0.0268 1
Leishmania major putative PfkB family sugar kinase 0.0308 0.0268 1
Schistosoma mansoni ribokinase 0.0308 0.0268 1
Entamoeba histolytica ribokinase, putative 0.0308 0.0268 0.5
Mycobacterium ulcerans fructokinase, PfkB 0.0308 0.0268 0.5
Entamoeba histolytica kinase, PfkB family 0.0308 0.0268 0.5
Trypanosoma cruzi adenosine kinase, putative 0.0308 0.0268 1
Entamoeba histolytica tagatose-6-phosphate kinase, putative 0.0308 0.0268 0.5
Loa Loa (eye worm) hypothetical protein 0.0308 0.0268 0.0268
Loa Loa (eye worm) hypothetical protein 0.0211 0.0146 0.0146
Echinococcus granulosus adenosine kinase 0.0308 0.0268 1
Mycobacterium tuberculosis 6-phosphofructokinase PfkB (phosphohexokinase) (phosphofructokinase) 0.0308 0.0268 0.5
Onchocerca volvulus Putative pyridoxal kinase 0.0308 0.0268 0.0104
Loa Loa (eye worm) hypothetical protein 0.0173 0.0098 0.0098
Trichomonas vaginalis ribokinase, putative 0.0308 0.0268 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0308 0.0268 0.5
Schistosoma mansoni nAChR subunit (ShAR1-beta-like) 0.0227 0.0166 0.5666
Giardia lamblia Ribokinase 0.0308 0.0268 0.5
Loa Loa (eye worm) hypothetical protein 0.8021 1 1
Entamoeba histolytica Hypothetical protein T24C12.3, putative 0.0308 0.0268 0.5
Leishmania major adenosine kinase-like protein 0.0308 0.0268 1
Loa Loa (eye worm) hypothetical protein 0.0227 0.0166 0.0166
Brugia malayi Ribokinase 0.0308 0.0268 0.0154
Leishmania major tagatose-6-phosphate kinase-like protein 0.0308 0.0268 1
Loa Loa (eye worm) hypothetical protein 0.0173 0.0098 0.0098
Onchocerca volvulus Ribokinase homolog 0.0308 0.0268 0.0104
Trichomonas vaginalis ribokinase, putative 0.0308 0.0268 0.5
Mycobacterium tuberculosis Ribokinase RbsK 0.0308 0.0268 0.5
Leishmania major ribokinase, putative 0.0308 0.0268 1
Trypanosoma cruzi adenosine kinase, putative 0.0308 0.0268 1
Loa Loa (eye worm) hypothetical protein 0.0227 0.0166 0.0166
Trypanosoma brucei ribokinase, putative 0.0308 0.0268 1
Loa Loa (eye worm) hypothetical protein 0.0308 0.0268 0.0268
Entamoeba histolytica fructokinase, putative 0.0308 0.0268 0.5
Echinococcus granulosus ribokinase 0.0308 0.0268 1
Brugia malayi Adenosine kinase-like 0.0308 0.0268 0.0154
Brugia malayi Cation transporter family protein 0.0227 0.0166 0.0051
Mycobacterium leprae Probable adenosine kinase adk 0.0308 0.0268 0.5
Trypanosoma brucei adenosine kinase, putative 0.0308 0.0268 1
Echinococcus multilocularis pseudouridine metabolizing bifunctional protein 0.0308 0.0268 1
Schistosoma mansoni adenosine kinase 0.0308 0.0268 1
Trypanosoma cruzi ribokinase, putative 0.0308 0.0268 1

Activities

No activities found for this compound.

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.